SCHEMBL14354031

SCHEMBL14354031

COC(=O)c1nc(-c2ccc(Cl)c(OC)c2F)c(F)c(N)c1SC

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.36
▸ PKM P14618 3/20 0.36
▸ RCE1 Q9Y256 1/20 0.36
▸ MEP1B Q16820 1/20 0.35
▸ LHCGR P22888 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ TAS1R3 Q7RTX0 2/20 0.33
▸ TAS1R1 Q7RTX1 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TAS1R2 Q8TE23 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CFTR P13569 1/20 0.31
▸ UCHL3 P15374 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ TP53 P04637 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14354469 0.89 KDM4E (0.39) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL29489593 0.87 KDM4E (0.38) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL3330070 0.87 KDM4E (0.38) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL15799996 0.87 MEP1B (0.31) MEP1BLHCGR
SCHEMBL14479765 0.84 LHCGR (0.33) KDM4ELHCGRL3MBTL1POLBCFTR
SCHEMBL1397046 0.83 KDM4E (0.38) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL14353839 0.83 KDM4E (0.38) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL18559787 0.83 MEP1B (0.36) KDM4EPKMRCE1MEP1BALDH1A1
SCHEMBL16076567 0.82 KDM4E (0.36) KDM4EPKMRCE1LHCGRALDH1A1
SCHEMBL24985552 0.81 TAS1R3 (0.40) KDM4EPKMRCE1MEP1BALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2725903-B1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2020-04-15 — — EP disclosed
US-9518018-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2016-12-13 — — US disclosed
US-9518018-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2016-12-13 — — US disclosed
US-9518018-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2016-12-13 — — US disclosed
US-20150133301-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2015-05-14 — — US disclosed
US-20150133301-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2015-05-14 — — US disclosed
US-20150133301-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2015-05-14 — — US disclosed
US-8754229-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-06-17 — — US disclosed
US-8754229-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-06-17 — — US disclosed
US-8754229-B2 3-alkoxy, thioalkyl and amino-4-amino-6-(substituted)picolinates and their use as herbicides DOW AGROSCIENCES, LLC. (US) 2014-06-17 — — US disclosed
US-20130005574-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC 2013-01-03 — — US disclosed
US-20130005574-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC 2013-01-03 — — US disclosed
US-20130005574-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC 2013-01-03 — — US disclosed
WO-2013003740-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2013-01-03 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130005574-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DDT, AADAC, AADAT KDM4E 1083/4885PKM 2079/4885RCE1 2760/4885
US-20150133301-A1 3-ALKOXY, THIOALKYL AND AMINO-4-AMINO-6-(SUBSTITUTED)PICOLINATES AND THEIR USE AS HERBICIDES DDT, AADAC, AADAT KDM4E 1083/4885PKM 2079/4885RCE1 2760/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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